5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid
TL;DR: 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid (CAS 435341-95-0) is a chemical compound with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-pyridin-4-yl-1,2-oxazole-4-carboxylic acid
Also Known As: 5-Methyl-3-pyridin-4-yl-isoxazole-4-carboxylic acid, 5-methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid, AKOS BBS-00004593, 2809AF, 5-methyl-3-(4-pyridyl)isoxazole-4-carboxylic acid
| Molecular Formula | C10H8N2O3 |
|---|---|
| Molecular Weight | 204.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.0535 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 435341-95-0 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=NC=C2)C(=O)O |
| InChIKey | WHOBCXXYJKABST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid (CAS 435341-95-0), with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol. IUPAC: 5-methyl-3-pyridin-4-yl-1,2-oxazole-4-carboxylic acid.
Chemical Property Profile of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid
Property Insights of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid. Following Lipinski's Rule of Five, 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid?
The CAS number of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid is 435341-95-0.
What is the molecular formula of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid?
The molecular formula of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid is C10H8N2O3.
What is the molecular weight of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid?
The molecular weight of 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid is 204.05 g/mol.
Where can I buy 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid?
You can request a quote for 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-3-(pyridin-4-yl)-1,2-oxazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.